SCHEMBL537549

SCHEMBL537549

COC(=O)CCNCc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.58
CA12 O43570 1/20 0.56
CA7 P43166 1/20 0.56
CA9 Q16790 1/20 0.56
CA14 Q9ULX7 1/20 0.56
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
TDP1 Q9NUW8 1/20 0.55
ATM Q13315 1/20 0.55
ALDH1A1 P00352 3/20 0.53
HDAC3 O15379 2/20 0.53
HDAC1 Q13547 2/20 0.53
HDAC2 Q92769 2/20 0.53
HDAC8 Q9BY41 2/20 0.53
NCOR2 Q9Y618 2/20 0.53
LMNA P02545 2/20 0.53
KDM4E B2RXH2 2/20 0.53
MAOA P21397 1/20 0.50
CHRM2 P08172 1/20 0.48
GAA P10253 1/20 0.48

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Water SCHEMBL28846002 0.98 LTA4H (0.57) LTA4HCA12CA7CA9CA14
SCHEMBL8850869 0.90 HDAC3 (0.58) CA12CA7CA9CA14MEN1
Hydrochloric Acid SCHEMBL28493003 0.88 HDAC3 (0.56) CA12CA7CA9CA14MEN1
SCHEMBL19438874 0.88 HDAC3 (0.65) CA12CA7CA9CA14MEN1
SCHEMBL3143537 0.87 LTA4H (0.64) LTA4HMEN1KMT2AATM
SCHEMBL16730575 0.87 HDAC3 (0.66) MEN1KMT2AATMALDH1A1HDAC3
SCHEMBL13903744 0.87 HDAC3 (0.66) MEN1KMT2AATMALDH1A1HDAC3
SCHEMBL16503433 0.85 LTA4H (0.48) LTA4HCA12CA7CA9CA14
SCHEMBL549268 0.85 LTA4H (0.60) LTA4HMEN1KMT2ATDP1ATM
SCHEMBL13870210 0.84 CHRM2 (0.53) LTA4HCA12CA7CA9CA14

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 98 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117447334-A Method for efficiently synthesizing alpha-amino acetal 南京工业大学 2024-01-26 CN claimed
US-20260108618-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF VIRAL INFECTIONS CIDARA THERAPEUTICS, INC. 2026-04-23 US disclosed
EP-4719602-A1 ANTI-HIV COMPOUNDS GILEAD SCIENCES, INC. (US) 2026-04-08 EP disclosed
US-12569565-B2 Compositions and methods for the treatment of viral infections CIDARA THERAPEUTICS, INC. (US) 2026-03-10 US disclosed
US-12427200-B2 Compositions and methods for the treatment of viral infections CIDARA THERAPEUTICS, INC. (US) 2025-09-30 US disclosed
US-20250051375-A1 ANTI-HIV COMPOUNDS GILEAD SCIENCES, INC. 2025-02-13 US disclosed
WO-2024249517-A1 ANTI-HIV COMPOUNDS GILEAD SCIENCES, INC. (US) 2024-12-05 WO disclosed
WO-2024232599-A1 NOVEL BENZOTHIOPHENE DERIVATIVE INHIBITING BET PROTEIN AND COMPOSITION FOR TREATMENT OF CANCER, USING SAME 주식회사 베노바이오 2024-11-14 WO disclosed
US-20240156975-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF VIRAL INFECTIONS CIDARA THERAPEUTICS, INC. 2024-05-16 US disclosed
EP-4328230-A2 AMINO ACID COMPOUNDS AND METHODS OF USE Pliant Therapeutics, Inc. (US) 2024-02-28 EP disclosed
WO-2001009126-A1 SEROTONERGIC BENZOTHIOPHENES ELI LILLY AND COMPANY (US) 2001-02-08 WO disclosed
CN-1053472-C Oligonucleotides derived from the SOD family HOFFMANN LA ROCHE (CH) 2000-06-14 CN disclosed
CN-1041091-C Trisubstituted pyrimido [5,4-d] pyrimidines for modulating THOMAE GMBH DR K (DE) 1998-12-09 CN disclosed
US-5618814-A Trisubstituted pyrimido [5,4-d] pyrimidines for modulating multi-drug resistance and pharmaceutical compositions containing these compounds DR. KARL THOMAE GMBH (DE) 1997-04-08 US disclosed
CN-1106405-A Trisubstituted pyrimido [5,4-d] pyrimidines for modulating THOMAE GMBH DR K (DE) 1995-08-09 CN disclosed
US-4652560-A ANTIBIOTICS, BACTERICIDES BEECHAM GROUP P.L.C. (GB) 1987-03-24 US disclosed
US-4539202-A SYNERGISTIC MIXTURE WITH PENICILLINS BEECHAM GROUP P.L.C. (GB) 1985-09-03 US disclosed
EP-0025271-B1 DERIVATIVES OF CLAVULANIC ACID, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM BEECHAM GROUP PLC (GB) 1984-03-14 EP disclosed
EP-0025271-A1 Derivatives of clavulanic acid, their preparation and pharmaceutical compositions containing them BEECHAM GROUP PLC (GB) 1981-03-18 EP disclosed
US-4231933-A Novel 3-hydroxy-pyrrolin-2-one derivatives WARNER-LAMBERT COMPANY (US) 1980-11-04 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-12427200-B2 Compositions and methods for the treatment of viral infections FCGR3B, ALB, FCGR1A LTA4H 1204/4885CA12 399/4885CA7 805/4885
US-20250051375-A1 ANTI-HIV COMPOUNDS CCR5, CD4, NFATC1 LTA4H 2455/4885CA12 4488/4885CA7 3634/4885
US-20260108618-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF VIRAL INFECTIONS FCGR3B, FCGR1A, FCGR2A LTA4H 1939/4885CA12 1209/4885CA7 1239/4885
US-12569565-B2 Compositions and methods for the treatment of viral infections ALB, FCGR3B, FCGR1A LTA4H 1363/4885CA12 1326/4885CA7 1036/4885
US-20240156975-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF VIRAL INFECTIONS FCGR3B, ALB, FCGR1A LTA4H 1204/4885CA12 399/4885CA7 805/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.